Compound C11H14N5O6PS

6-[6-amino-8-(sulfanylmethyl)purin-9-yl]-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol

CAS: 61866-10-2

Molecular Formula	`C11H14N5O6PS`
Molecular Weight	375.3 g/mol
LogP	-2.4
Topological Polar Surface Area	156.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	11
Rotatable Bonds	2
Exact Mass	375.04025
Heavy Atoms	24
Complexity	547.0

Chemical Identifiers

CAS Number	61866-10-2
SMILES	`C1C2C(C(C(O2)N3C(=NC4=C(N=CN=C43)N)CS)O)OP(=O)(O1)O`
InChIKey	`GPUNSPOSQRRPTH-UHFFFAOYSA-N`

📖 Product Overview

Compound C11H14N5O6PS (CAS: 61866-10-2) is a chemical compound with molecular formula C11H14N5O6PS and molecular weight 375.3 g/mol. Its IUPAC systematic name is 6-[6-amino-8-(sulfanylmethyl)purin-9-yl]-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol. LogP -2.4 Topological Polar Surface Area 156.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 11 Rotatable Bonds 2 Exact Mass 375.04025 Heavy Atoms 24 Complexity 547.0 InChI Key: GPUNSPOSQRRPTH-UHFFFAOYSA-N. SMILES: C1C2C(C(C(O2)N3C(=NC4=C(N=CN=C43)N)CS)O)OP(=O)(O1)O.

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